1-ethyl-4-[[(2S)-3-methylbutan-2-yl]amino]-N-[[4-(methylcarbamoyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1-ethyl-4-[[(2S)-3-methylbutan-2-yl]amino]-N-[[4-(methylcarbamoyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[[(1S)-1,2-dimethylpropyl]amino]-1-ethyl-N-[[4-(methylcarbamoyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1-ethyl-4-[[(2S)-3-methylbutan-2-yl]amino]-N-[[4-(methylcarbamoyl)phenyl]methyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-ethyl-4-[[(2S)-3-methylbutan-2-yl]amino]-N-[[4-(methylcarbamoyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[[(1S)-1,2-dimethylpropyl]amino]-1-ethyl-N-[4-(methylcarbamoyl)benzyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C23H30N6O2 MolecularWeight: 422.5233

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC(C)C(C)C)C(=O)NCC3=CC=C(C=C3)C(=O)NC

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)N[C@@H](C)C(C)C)C(=O)NCC3=CC=C(C=C3)C(=O)NC

InChI

InChI=1S/C23H30N6O2/c1-6-29-21-18(13-27-29)20(28-15(4)14(2)3)19(12-25-21)23(31)26-11-16-7-9-17(10-8-16)22(30)24-5/h7-10,12-15H,6,11H2,1-5H3,(H,24,30)(H,25,28)(H,26,31)/t15-/m0/s1